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Home> Hot Product Listed O   > OPHIOPOGONIN D
1120-21-4 structure

OPHIOPOGONIN D

CAS No.:1120-21-4
Molecular Weight:156.30826
Molecular Formula:C31H39N5O4S2 (isomer)
Names and Identifiers
Synonyms

(3β,25R)- Diosgenin 3-O-[alpha-L-rhamnopyranosyl-(1-2)][beta-D-xylopyranosyl-(1-3)]-beta-D-glucopyranoside β-D-gluco

Inchi
InChI=1/C11H24/c1-3-5-7-9-11-10-8-6-4-2/h3-11H2,1-2H3
InChkey
RSJKGSCJYJTIGS-UHFFFAOYSA-N
Canonical Smiles
CCCCCCCCCCC
Properties
Density
1.43
Melting Point
-26℃
Boiling Point
613.2°C at 760 mmHg
Vapour
0.564mmHg at 25°C
Refractive Index
1.416-1.418
HS Code
29011090
Safety and Handling
Risk Statements
R36/37/38
Safety Statements
S24/25
HazardClass
3
Hazard Note
H304
PackingGroup
III
Transport
UN 2330
Reach Info
This substance has been officially registered by enterprises.
ECHA (EU chemicals Management Agency) published the completed registration file as follows:
Completed registration file:
Registered as ubmitted Total tonnage band  
FULL JOINT 100_1000 view >
Registered companies:
Registrant / Supplier details Latest dossier received
Haltermann Carless Deutschland GmbH 2016
Handelmaatschappij A. Smit en Zoon B.V. 2013
more >
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Aspiration hazard, Category 1

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H304 May be fatal if swallowed and enters airways

Precautionary statement(s)
Prevention

none

Response

P301+P310 IF SWALLOWED: Immediately call a POISON CENTER/doctor/\u2026

P331 Do NOT induce vomiting.

Storage

P405 Store locked up.

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:156.30826g/mol
  • Molecular Formula:C31H39N5O4S2
  • XLogP3-AA:5.6
  • Exact Mass:156.187801
  • Monoisotopic Mass:156.187801
  • Complexity:49.1
  • Rotatable Bond Count:8
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:0
  • Topological Polar Surface Area:0
  • Heavy Atom Count:11
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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